Text Search
Structure Search

tert-butyl 4-(azetidin-3-yl)piperazine-1-carboxylate dihydrochloride

tert-butyl 4-(azetidin-3-yl)piperazine-1-carboxylate dihydrochloride

CAS: 1803566-76-8

Formula: C12H25Cl2N3O2

SMILES: Cl.Cl.CC(C)(C)OC(=O)N1CCN(CC1)C1CNC1

IUPAC: tert-butyl 4-(azetidin-3-yl)piperazine-1-carboxylate dihydrochloride

InChI: InChI=1S/C12H23N3O2.2ClH/c1-12(2,3)17-11(16)15-6-4-14(5-7-15)10-8-13-9-10;;/h10,13H,4-9H2,1-3H3;2*1H

Composition: C (45.87%), H (8.02%), Cl (22.56%), N (13.37%), O (10.18%)

Molar Mass: 314.25

Atom Count: 44

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 313.1323825
Formal Charge 0
FSP3 0.92
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey OIIUNYFYTGWBKR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.16
Topological Polar Surface Area 44.81
Polarizability 26.34
Ring Count 2
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1803566-76-8 $590.00$590.00
Request Quote